SCHEMBL1438568

SCHEMBL1438568

CC(C)(C)N[C@H]1CN(C(=O)O)CC[C@@H]1O

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 1/20 0.31
JAK3 P52333 2/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1437707 0.87 LMNA (0.39) LMNASMN1; SMN2ALDH1A1
SCHEMBL3746174 0.84 LMNA (0.32) LMNA
SCHEMBL512168 0.84 LMNA (0.32) LMNA
SCHEMBL22497045 0.83 LMNA (0.39) LMNASMN1; SMN2ALDH1A1JAK3
SCHEMBL23130508 0.82 LMNA (0.38) LMNASMN1; SMN2ALDH1A1JAK3
SCHEMBL22441070 0.82 LMNA (0.38) LMNASMN1; SMN2ALDH1A1JAK3
SCHEMBL22441066 0.82 LMNA (0.38) LMNASMN1; SMN2ALDH1A1JAK3
SCHEMBL30419013 0.81 JAK3 (0.36) LMNASMN1; SMN2JAK3
SCHEMBL650847 0.80 LMNA (0.36) LMNASMN1; SMN2
SCHEMBL652815 0.80 LMNA (0.36) LMNASMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011023693-A1 METHYLPYRROLOPYRIMIDINECARBOXAMIDES NYCOMED GMBH (DE) 2011-03-03 WO disclosed